Match Geometry [1]
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_min_autotools: [foss2023a-mpi] >
Input 23-go-na2.02-simplex.inp
Value | Reference | Precision | Status |
-1.526284000000000e+00 | -1.526284000000000e+00 | 7.630000000000000e-06 | PASS |
Command: LINEFIELD(min.xyz, 3, 4)